2-[[4-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]-6-(4-dimethylaminophenyl)pyrimidin-2-yl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-[[4-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]-6-(4-dimethylaminophenyl)pyrimidin-2-yl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide Openeye Name: 2-[[4-(2,4-dichloro-5-fluoro-phenyl)-6-(4-dimethylaminophenyl)pyrimidin-2-yl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide CAS Name: 2-[[4-(2,4-dichloro-5-fluorophenyl)-6-(4-dimethylaminophenyl)-2-pyrimidinyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide IUPAC Name: 2-[[4-(2,4-dichloro-5-fluorophenyl)-6-(4-dimethylaminophenyl)pyrimidin-2-yl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide Traditional Name: 2-[[4-(2,4-dichloro-5-fluoro-phenyl)-6-(4-dimethylaminophenyl)pyrimidin-2-yl]amino]-N-homoveratryl-acetamide Formula: C30H30Cl2FN5O3 MolecularWeight: 598.495303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=CC(=NC(=N2)NCC(=O)NCCC3=CC(=C(C=C3)OC)OC)C4=CC(=C(C=C4Cl)Cl)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=CC(=NC(=N2)NCC(=O)NCCC3=CC(=C(C=C3)OC)OC)C4=CC(=C(C=C4Cl)Cl)F

InChI

InChI=1S/C30H30Cl2FN5O3/c1-38(2)20-8-6-19(7-9-20)25-16-26(21-14-24(33)23(32)15-22(21)31)37-30(36-25)35-17-29(39)34-12-11-18-5-10-27(40-3)28(13-18)41-4/h5-10,13-16H,11-12,17H2,1-4H3,(H,34,39)(H,35,36,37)